SCHEMBL18121970

SCHEMBL18121970

Cc1nnc(-c2ccc(CNC(=O)CON)cc2)nn1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ KMT2A Q03164 3/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ ALDH1A1 P00352 3/20 0.41
▸ HTT P42858 2/20 0.41
▸ LMNA P02545 1/20 0.41
▸ HPGD P15428 2/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ XDH P47989 1/20 0.40
▸ TPSAB1 Q15661 2/20 0.40
▸ CYP1A2 P05177 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ EPHX2 P34913 1/20 0.39
▸ NR1H4 Q96RI1 1/20 0.39
▸ TP53 P04637 2/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL22415053 0.85 SMN1; SMN2 (0.39) SMN1; SMN2KMT2AMEN1ALDH1A1HTT
SCHEMBL25939697 0.83 HPGD (0.44) SMN1; SMN2KMT2AMEN1ALDH1A1HTT
SCHEMBL18119800 0.83 POLB (0.46) SMN1; SMN2KMT2AMEN1ALDH1A1HTT
SCHEMBL18119788 0.80 KMT2A (0.56) SMN1; SMN2KMT2AALDH1A1
SCHEMBL25457352 0.80 HTT (0.58) KMT2AMEN1ALDH1A1HTTLMNA
SCHEMBL18270260 0.78 SMN1; SMN2 (0.40) SMN1; SMN2KMT2AMEN1HPGDTPSAB1
SCHEMBL31041169 0.78 TPSAB1 (0.43) SMN1; SMN2KMT2AMEN1ALDH1A1HTT
SCHEMBL31041170 0.78 TPSAB1 (0.43) SMN1; SMN2KMT2AMEN1ALDH1A1HTT
SCHEMBL29780633 0.78 TPSAB1 (0.43) SMN1; SMN2KMT2AMEN1ALDH1A1HTT
SCHEMBL17056078 0.78 TPSAB1 (0.40) SMN1; SMN2KMT2AMEN1ALDH1A1HTT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160287734-A1 18F LABELING OF PROTEINS USING SORTASES WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2016-10-06 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160287734-A1 18F LABELING OF PROTEINS USING SORTASES SORT1, ANPEP, SPG11 SMN1; SMN2 4600/4885KMT2A 4765/4885MEN1 1747/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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